N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide

C13H11ClN2O2 — CID 731708

IUPACN-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cccnc2)cc1Cl
InChIInChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(7-11(12)14)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17)
InChIKeyVRDHSPFDAUFANO-UHFFFAOYSA-N
MW262.70 g/mol
LogP3.00
Rot. Bonds3

About N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide

N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 731708) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide
PubChem CID731708
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC NameN-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cccnc2)cc1Cl
InChIInChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(7-11(12)14)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17)
InChIKeyVRDHSPFDAUFANO-UHFFFAOYSA-N
XLogP3.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]pyridine-3-carboxamide
CID 21229425
N-(3-chloro-4-methoxyphenyl)-6-methylpyridine-3-carboxamide
CID 18150443
N-[3-chloro-4-(4-fluorophenoxy)phenyl]pyridine-3-carboxamide
CID 154695915
N-(2,5-dichloro-4-methoxyphenyl)pyridine-3-carboxamide;hydrochloride
CID 110777674
6-amino-N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide
CID 62060820
N-(3-chloro-4-methoxyphenyl)quinoxaline-6-carboxamide
CID 110690558
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
1-(3-chloro-4-methoxyphenyl)-3-pyridin-3-ylpropane-1,3-dione
CID 58626094
N-(3-chloro-4-methoxyphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62184786
N-(4-chloro-3-fluorophenyl)pyridine-3-carboxamide
CID 47227911
N-(3-chloro-4-methoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109235708
6-N-(3-chloro-4-methoxyphenyl)-2-N-(pyridin-3-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098282

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide (CID 731708) is N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide is COc1ccc(NC(=O)c2cccnc2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is VRDHSPFDAUFANO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(7-11(12)14)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17).
What are the key properties of N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide?
N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 262.70 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 731708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).